PUBCHEM-ZINC05692750 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 0.0360 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 2.1800 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7140 1.5910 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 3.3980 -0.0140 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2390 -2.0760 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.7960 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.0950 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -4.8520 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -4.1650 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -4.8400 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -6.2480 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -6.9510 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -6.2390 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -8.3590 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -8.9890 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 -8.2380 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -6.9270 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -0.4870 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -2.5470 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -4.6190 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -3.0850 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5440 -4.2970 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -6.7650 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -8.9250 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -10.0680 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 -8.7490 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 22 2 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END